10-[2-[7-[2-(9,9-dimethylacridin-10-yl)phenyl]-9,9-dimethylfluoren-2-yl]phenyl]-9,9-dimethylacridine

C57H48N2 — CID 130438692

IUPAC10-[2-[7-[2-(9,9-dimethylacridin-10-yl)phenyl]-9,9-dimethylfluoren-2-yl]phenyl]-9,9-dimethylacridine
SMILESCC1(C)c2cc(-c3ccccc3N3c4ccccc4C(C)(C)c4ccccc43)ccc2-c2ccc(-c3ccccc3N3c4ccccc4C(C)(C)c4ccccc43)cc21
InChIInChI=1S/C57H48N2/c1-55(2)43-21-9-15-27-51(43)58(52-28-16-10-22-44(52)55)49-25-13-7-19-39(49)37-31-33-41-42-34-32-38(36-48(42)57(5,6)47(41)35-37)40-20-8-14-26-50(40)59-53-29-17-11-23-45(53)56(3,4)46-24-12-18-30-54(46)59/h7-36H,1-6H3
InChIKeyJOIFDVXAWDXDNZ-UHFFFAOYSA-N
MW761.03 g/mol
LogP15.55
Rot. Bonds4

About 10-[2-[7-[2-(9,9-dimethylacridin-10-yl)phenyl]-9,9-dimethylfluoren-2-yl]phenyl]-9,9-dimethylacridine

10-[2-[7-[2-(9,9-dimethylacridin-10-yl)phenyl]-9,9-dimethylfluoren-2-yl]phenyl]-9,9-dimethylacridine (PubChem CID 130438692) has the molecular formula C57H48N2 and a molecular weight of 761.03 g/mol. Its IUPAC name is 10-[2-[7-[2-(9,9-dimethylacridin-10-yl)phenyl]-9,9-dimethylfluoren-2-yl]phenyl]-9,9-dimethylacridine.

Molecular Properties

Compound Name10-[2-[7-[2-(9,9-dimethylacridin-10-yl)phenyl]-9,9-dimethylfluoren-2-yl]phenyl]-9,9-dimethylacridine
PubChem CID130438692
Molecular FormulaC57H48N2
Molecular Weight761.03 g/mol
Exact Mass760.38
IUPAC Name10-[2-[7-[2-(9,9-dimethylacridin-10-yl)phenyl]-9,9-dimethylfluoren-2-yl]phenyl]-9,9-dimethylacridine
SMILESCC1(C)c2cc(-c3ccccc3N3c4ccccc4C(C)(C)c4ccccc43)ccc2-c2ccc(-c3ccccc3N3c4ccccc4C(C)(C)c4ccccc43)cc21
InChIInChI=1S/C57H48N2/c1-55(2)43-21-9-15-27-51(43)58(52-28-16-10-22-44(52)55)49-25-13-7-19-39(49)37-31-33-41-42-34-32-38(36-48(42)57(5,6)47(41)35-37)40-20-8-14-26-50(40)59-53-29-17-11-23-45(53)56(3,4)46-24-12-18-30-54(46)59/h7-36H,1-6H3
InChIKeyJOIFDVXAWDXDNZ-UHFFFAOYSA-N
XLogP15.55
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms59
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500761.03
LogP ≤ 515.55
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 10-[2-[7-[2-(9,9-dimethylacridin-10-yl)phenyl]-9,9-dimethylfluoren-2-yl]phenyl]-9,9-dimethylacridine with MolForge

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Related Compounds

10-[4-(9,9-dimethylfluoren-2-yl)phenyl]-9,9-dimethylacridine
CID 155244755
10-[2-[2-[2-(9,9-dimethylacridin-10-yl)phenyl]-5,5-dimethylbenzo[b][1]benzosilol-8-yl]phenyl]-9,9-dimethylacridine
CID 153320402
2-[4-(9,9-dimethylfluoren-2-yl)naphthalen-1-yl]-9,9-dimethylfluorene
CID 59133432
10-fluoranthen-3-yl-2-(10-fluoranthen-3-yl-9,9-dimethylacridin-2-yl)-9,9-dimethylacridine
CID 70936023
9,9-dimethyl-10-(7-phenyl-9,9'-spirobi[fluorene]-4-yl)acridine
CID 129258942
2-[3,5-bis[7-[7-[7-(9,9-dimethylfluoren-2-yl)-9,9-dimethylfluoren-2-yl]-9,9-dimethylfluoren-2-yl]-9,9-dimethylfluoren-2-yl]phenyl]-7-[7-[7-(9,9-dimethylfluoren-2-yl)-9,9-dimethylfluoren-2-yl]-9,9-dimethylfluoren-2-yl]-9,9-dimethylfluorene
CID 101336380
2,7-bis[3,5-bis[3,5-bis(9,9-dimethylfluoren-2-yl)phenyl]phenyl]-9,9-dimethylfluorene
CID 58881238
14-(9,9-dimethyl-7-phenylfluoren-2-yl)-10,10,21,21-tetramethyl-14-azapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene
CID 130439455
18-(9,9-dimethyl-10-phenylacridin-2-yl)-10,10,21,21-tetramethyl-14-phenyl-14-azapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15(20),16,18-nonaene
CID 118227857
9,9-dimethyl-2-(2-methylphenyl)fluorene
CID 58389997
8,8,14,14-tetramethyl-11-[4-[4-(8,8,14,14-tetramethyl-1-azapentacyclo[11.7.1.02,7.09,21.015,20]henicosa-2,4,6,9,11,13(21),15,17,19-nonaen-11-yl)phenyl]phenyl]-1-azapentacyclo[11.7.1.02,7.09,21.015,20]henicosa-2,4,6,9,11,13(21),15,17,19-nonaene
CID 90330276
10,10,14,14-tetramethyl-21-[5-(10,10,14,14-tetramethyl-21-azapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaen-21-yl)naphthalen-1-yl]-21-azapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene
CID 139459631

Frequently Asked Questions

What is the IUPAC name of 10-[2-[7-[2-(9,9-dimethylacridin-10-yl)phenyl]-9,9-dimethylfluoren-2-yl]phenyl]-9,9-dimethylacridine?
The IUPAC name of 10-[2-[7-[2-(9,9-dimethylacridin-10-yl)phenyl]-9,9-dimethylfluoren-2-yl]phenyl]-9,9-dimethylacridine (CID 130438692) is 10-[2-[7-[2-(9,9-dimethylacridin-10-yl)phenyl]-9,9-dimethylfluoren-2-yl]phenyl]-9,9-dimethylacridine.
What is the SMILES notation for 10-[2-[7-[2-(9,9-dimethylacridin-10-yl)phenyl]-9,9-dimethylfluoren-2-yl]phenyl]-9,9-dimethylacridine?
The canonical SMILES for 10-[2-[7-[2-(9,9-dimethylacridin-10-yl)phenyl]-9,9-dimethylfluoren-2-yl]phenyl]-9,9-dimethylacridine is CC1(C)c2cc(-c3ccccc3N3c4ccccc4C(C)(C)c4ccccc43)ccc2-c2ccc(-c3ccccc3N3c4ccccc4C(C)(C)c4ccccc43)cc21.
What is the InChIKey of 10-[2-[7-[2-(9,9-dimethylacridin-10-yl)phenyl]-9,9-dimethylfluoren-2-yl]phenyl]-9,9-dimethylacridine?
The InChIKey is JOIFDVXAWDXDNZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C57H48N2/c1-55(2)43-21-9-15-27-51(43)58(52-28-16-10-22-44(52)55)49-25-13-7-19-39(49)37-31-33-41-42-34-32-38(36-48(42)57(5,6)47(41)35-37)40-20-8-14-26-50(40)59-53-29-17-11-23-45(53)56(3,4)46-24-12-18-30-54(46)59/h7-36H,1-6H3.
What are the key properties of 10-[2-[7-[2-(9,9-dimethylacridin-10-yl)phenyl]-9,9-dimethylfluoren-2-yl]phenyl]-9,9-dimethylacridine?
10-[2-[7-[2-(9,9-dimethylacridin-10-yl)phenyl]-9,9-dimethylfluoren-2-yl]phenyl]-9,9-dimethylacridine has a molecular weight of 761.03 g/mol, XLogP of 15.55, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 10-[2-[7-[2-(9,9-dimethylacridin-10-yl)phenyl]-9,9-dimethylfluoren-2-yl]phenyl]-9,9-dimethylacridine is sourced from PubChem (CID 130438692), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).